==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NUCLEOTIDE-BINDING PROTEIN 11-FEB-97 3RHN . COMPND 2 MOLECULE: HISTIDINE TRIAD NUCLEOTIDE-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR C.BRENNER,P.GARRISON,J.GILMOUR,D.PEISACH,D.RINGE,G.A.PETSKO, . 115 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6948.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 64 55.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 19.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 7 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 18.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 12 A R 0 0 96 0, 0.0 2,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 -24.1 21.2 3.9 19.9 2 13 A P + 0 0 107 0, 0.0 45,-0.1 0, 0.0 11,-0.0 0.513 360.0 29.1 -85.5 158.1 23.6 4.1 17.8 3 14 A G S S- 0 0 8 43,-0.1 3,-0.2 -2,-0.1 9,-0.1 0.064 114.6 -92.7 115.7 -23.4 24.0 7.7 16.7 4 15 A G - 0 0 5 5,-0.1 95,-0.1 1,-0.1 8,-0.0 -0.257 35.8 -84.3 103.7 169.9 22.8 9.3 19.9 5 16 A D S S+ 0 0 145 4,-0.1 -1,-0.1 -2,-0.1 2,-0.1 0.295 93.7 93.7 -99.1 8.6 19.5 10.5 21.2 6 17 A T S >> S- 0 0 32 -3,-0.2 4,-1.2 92,-0.1 3,-0.7 -0.347 96.7 -94.9 -88.1 178.0 19.5 14.0 19.7 7 18 A I H 3> S+ 0 0 75 1,-0.2 4,-2.0 2,-0.2 9,-0.1 0.768 126.4 64.5 -63.5 -25.9 17.8 14.8 16.3 8 19 A F H 3> S+ 0 0 14 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.885 98.1 53.2 -64.9 -34.5 21.3 14.3 14.8 9 20 A G H <> S+ 0 0 0 -3,-0.7 4,-2.0 1,-0.2 -1,-0.2 0.909 108.1 50.6 -66.7 -38.4 21.1 10.7 15.9 10 21 A K H <>S+ 0 0 91 -4,-1.2 5,-2.9 2,-0.2 6,-0.8 0.871 110.2 49.6 -65.5 -36.6 17.7 10.4 14.1 11 22 A I H ><5S+ 0 0 13 -4,-2.0 3,-1.9 3,-0.2 -2,-0.2 0.959 109.5 51.1 -67.1 -45.7 19.3 11.9 10.9 12 23 A I H 3<5S+ 0 0 21 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.869 113.1 46.1 -58.3 -39.7 22.2 9.4 11.1 13 24 A R T 3<5S- 0 0 68 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.374 113.3-121.1 -85.4 3.2 19.7 6.6 11.4 14 25 A K T < 5S+ 0 0 109 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.1 0.750 74.3 129.7 61.8 28.9 17.6 8.0 8.5 15 26 A E S - 0 0 67 47,-0.1 3,-0.8 49,-0.1 4,-0.3 -0.969 66.1-118.3-152.0 157.5 30.4 18.6 23.4 52 63 A I G > S+ 0 0 61 -2,-0.3 3,-0.6 1,-0.3 37,-0.1 0.721 116.2 60.6 -72.6 -22.2 33.9 19.4 22.2 53 64 A S G 3 S+ 0 0 83 1,-0.2 -1,-0.3 -3,-0.0 36,-0.0 0.707 104.4 51.2 -75.4 -20.6 34.9 19.9 25.8 54 65 A A G < S+ 0 0 51 -3,-0.8 -1,-0.2 2,-0.0 -2,-0.2 0.455 83.1 114.6 -93.0 -7.2 34.0 16.2 26.3 55 66 A A < - 0 0 25 -3,-0.6 2,-0.2 -4,-0.3 -6,-0.0 -0.379 60.4-134.3 -64.8 143.7 36.0 14.9 23.3 56 67 A E > - 0 0 120 1,-0.1 3,-1.8 -2,-0.1 4,-0.1 -0.500 23.9-104.7 -95.8 170.4 38.9 12.6 24.3 57 68 A D G > S+ 0 0 148 1,-0.3 3,-1.0 2,-0.2 -1,-0.1 0.806 123.0 59.4 -60.7 -27.9 42.5 12.5 23.1 58 69 A A G 3 S+ 0 0 87 1,-0.2 3,-0.4 2,-0.1 4,-0.3 0.578 93.1 65.0 -75.8 -15.2 41.5 9.4 21.1 59 70 A D G <> S+ 0 0 8 -3,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.294 73.0 101.9 -89.2 5.0 38.9 11.5 19.2 60 71 A E H <> S+ 0 0 142 -3,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.891 80.9 43.2 -55.0 -52.0 41.6 13.6 17.6 61 72 A S H > S+ 0 0 95 -3,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.915 113.7 53.1 -62.8 -44.8 41.6 11.8 14.2 62 73 A L H > S+ 0 0 18 -4,-0.3 4,-1.2 1,-0.2 -2,-0.2 0.925 110.0 47.6 -55.9 -47.3 37.8 11.8 14.1 63 74 A L H X S+ 0 0 44 -4,-2.5 4,-0.9 1,-0.2 3,-0.5 0.897 112.5 48.6 -63.2 -42.7 37.7 15.5 14.8 64 75 A G H X S+ 0 0 31 -4,-2.1 4,-2.0 1,-0.2 3,-0.3 0.837 105.6 60.4 -66.5 -29.1 40.3 16.2 12.1 65 76 A H H X S+ 0 0 43 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.819 97.3 57.7 -67.7 -31.3 38.2 14.0 9.8 66 77 A L H X S+ 0 0 6 -4,-1.2 4,-1.5 -3,-0.5 -1,-0.2 0.824 108.8 47.4 -66.2 -34.7 35.2 16.3 10.1 67 78 A M H X S+ 0 0 108 -4,-0.9 4,-2.3 -3,-0.3 -2,-0.2 0.875 110.9 49.0 -74.4 -39.6 37.4 19.2 8.9 68 79 A I H X S+ 0 0 81 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.940 115.0 45.4 -66.0 -42.7 38.9 17.2 5.9 69 80 A V H X S+ 0 0 5 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.876 110.5 55.9 -65.9 -36.3 35.4 16.1 4.9 70 81 A G H X S+ 0 0 0 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.908 108.5 45.9 -63.1 -42.8 34.2 19.7 5.4 71 82 A K H X S+ 0 0 102 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.869 112.4 50.7 -69.9 -34.9 36.8 21.1 3.0 72 83 A K H X S+ 0 0 131 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.901 112.5 46.5 -68.7 -39.5 36.0 18.4 0.4 73 84 A C H X S+ 0 0 7 -4,-2.3 4,-1.0 2,-0.2 -1,-0.2 0.840 110.1 53.8 -69.2 -36.8 32.3 19.1 0.5 74 85 A A H <>S+ 0 0 0 -4,-1.8 5,-2.9 2,-0.2 3,-0.2 0.902 110.6 45.4 -63.6 -45.6 32.8 22.8 0.3 75 86 A A H ><5S+ 0 0 42 -4,-1.9 3,-1.5 1,-0.2 -2,-0.2 0.894 112.2 52.3 -64.9 -39.8 34.9 22.6 -2.8 76 87 A D H 3<5S+ 0 0 132 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.689 108.8 50.7 -68.9 -23.0 32.4 20.1 -4.3 77 88 A L T 3<5S- 0 0 62 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.286 123.5-107.4 -95.7 6.4 29.6 22.7 -3.6 78 89 A G T < 5 + 0 0 54 -3,-1.5 2,-2.2 1,-0.2 3,-0.3 0.688 65.3 150.6 79.2 23.0 31.6 25.4 -5.3 79 90 A L > < + 0 0 12 -5,-2.9 3,-0.7 1,-0.2 -1,-0.2 -0.400 18.6 143.2 -85.0 65.5 32.8 27.5 -2.3 80 91 A K T 3 + 0 0 168 -2,-2.2 -1,-0.2 1,-0.2 3,-0.1 0.649 62.0 58.1 -81.8 -16.9 35.9 28.5 -4.2 81 92 A K T 3 S- 0 0 229 1,-0.3 -1,-0.2 -3,-0.3 2,-0.1 0.411 120.6 -95.5 -88.5 3.1 36.1 32.1 -3.0 82 93 A G < - 0 0 35 -3,-0.7 25,-0.6 -8,-0.1 -1,-0.3 -0.456 37.6-142.8 115.0 175.2 36.3 30.6 0.6 83 94 A Y E -D 106 0A 93 23,-0.2 2,-0.4 -2,-0.1 23,-0.2 -0.944 16.1-114.0-165.4 178.4 34.3 29.7 3.7 84 95 A R E -D 105 0A 58 21,-2.3 21,-2.2 -2,-0.3 2,-0.4 -0.997 17.2-151.9-132.0 133.4 34.3 29.7 7.5 85 96 A M E -D 104 0A 53 -2,-0.4 2,-0.4 19,-0.2 19,-0.2 -0.873 18.5-170.8-103.1 139.8 34.2 26.6 9.7 86 97 A V E -D 103 0A 41 17,-2.1 17,-3.2 -2,-0.4 2,-0.4 -0.997 18.6-173.1-139.3 136.7 32.6 26.9 13.2 87 98 A V - 0 0 74 -2,-0.4 2,-0.5 15,-0.2 15,-0.1 -0.997 16.3-157.2-124.2 120.4 32.3 24.7 16.3 88 99 A N - 0 0 46 -2,-0.4 2,-0.5 13,-0.4 -36,-0.2 -0.876 5.7-165.3-102.1 132.0 30.1 26.1 19.1 89 100 A E > - 0 0 59 -2,-0.5 4,-1.1 -38,-0.1 5,-0.2 -0.963 44.4 -44.6-122.6 119.4 30.6 24.9 22.7 90 101 A G H >>S- 0 0 18 -2,-0.5 5,-2.2 3,-0.2 4,-1.3 0.041 96.4 -33.0 67.0-165.4 28.1 25.4 25.5 91 102 A S H >45S+ 0 0 116 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.930 136.8 44.0 -57.1 -56.8 26.0 28.4 26.5 92 103 A D H 345S+ 0 0 170 1,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.768 113.3 52.6 -63.4 -30.3 28.4 31.2 25.5 93 104 A G H 3<5S- 0 0 32 -4,-1.1 -1,-0.3 -3,-0.1 -2,-0.2 0.735 113.3-119.2 -77.6 -20.5 29.3 29.4 22.2 94 105 A G T <<5 + 0 0 48 -4,-1.3 -3,-0.2 -3,-0.8 -2,-0.1 0.602 50.3 168.3 91.5 15.5 25.6 29.2 21.4 95 106 A Q < + 0 0 14 -5,-2.2 -1,-0.2 1,-0.2 3,-0.1 -0.361 11.7 164.9 -64.7 135.0 25.4 25.4 21.2 96 107 A S + 0 0 97 1,-0.2 2,-0.5 -8,-0.1 -1,-0.2 0.538 60.7 61.0-123.4 -23.9 21.9 24.1 21.0 97 108 A V S S- 0 0 25 2,-0.1 2,-1.4 -91,-0.1 -1,-0.2 -0.941 72.0-146.0-111.8 124.4 22.4 20.5 19.9 98 109 A Y S S+ 0 0 133 -2,-0.5 2,-0.3 -3,-0.1 -47,-0.1 -0.413 73.4 89.9 -89.5 58.5 24.5 18.3 22.2 99 110 A H S S- 0 0 0 -2,-1.4 -49,-0.2 -51,-0.1 -2,-0.1 -0.916 91.5-103.0-147.2 121.4 26.1 16.2 19.5 100 111 A V + 0 0 6 -51,-3.1 2,-0.3 -2,-0.3 -51,-0.1 -0.231 51.3 170.3 -53.3 132.7 29.4 17.6 18.2 101 112 A H - 0 0 10 -13,-0.2 2,-0.5 -57,-0.2 -13,-0.4 -0.995 29.2-140.0-148.7 147.0 29.0 19.3 14.8 102 113 A L E -C 43 0A 8 -59,-2.2 -59,-2.2 -2,-0.3 2,-0.3 -0.948 17.6-147.4-110.2 125.3 31.0 21.5 12.5 103 114 A H E -CD 42 86A 25 -17,-3.2 -17,-2.1 -2,-0.5 2,-0.4 -0.693 10.8-169.3 -88.8 140.9 29.3 24.3 10.6 104 115 A V E +CD 41 85A 0 -63,-2.3 -63,-2.1 -2,-0.3 2,-0.4 -0.982 10.7 175.8-132.0 116.9 30.6 25.3 7.1 105 116 A L E +CD 40 84A 15 -21,-2.2 -21,-2.3 -2,-0.4 2,-0.3 -0.975 12.4 134.5-123.2 143.1 29.2 28.5 5.7 106 117 A G E +CD 39 83A 0 -67,-2.2 -67,-2.4 -2,-0.4 -23,-0.2 -0.950 27.4 93.7-167.8-179.6 30.1 30.2 2.4 107 118 A G S S+ 0 0 53 -25,-0.6 2,-0.3 1,-0.3 -24,-0.1 0.391 93.4 48.2 100.7 -4.1 28.7 31.9 -0.7 108 119 A R S S- 0 0 108 -26,-0.2 2,-0.4 -69,-0.1 -1,-0.3 -0.952 101.3 -75.6-155.2 168.9 29.0 35.4 0.8 109 120 A Q - 0 0 153 -2,-0.3 2,-0.4 -3,-0.1 -3,-0.1 -0.617 44.6-141.8 -74.7 127.2 31.6 37.5 2.6 110 121 A M - 0 0 25 -2,-0.4 2,-0.1 -5,-0.1 -73,-0.0 -0.786 20.2-142.9 -90.5 133.4 31.9 36.4 6.2 111 122 A N - 0 0 111 -2,-0.4 -1,-0.0 2,-0.1 0, 0.0 -0.313 18.2 -86.1 -91.7 176.1 32.4 39.3 8.6 112 123 A W S S+ 0 0 199 2,-0.1 0, 0.0 -2,-0.1 0, 0.0 -0.996 98.4 44.4-135.9 139.5 34.4 39.8 11.8 113 124 A P S S- 0 0 97 0, 0.0 2,-2.3 0, 0.0 -2,-0.1 0.520 87.1-128.0 -62.9 157.0 34.0 39.3 14.8 114 125 A P 0 0 78 0, 0.0 -2,-0.1 0, 0.0 -4,-0.0 -0.323 360.0 360.0 -80.0 60.5 32.6 35.8 14.2 115 126 A G 0 0 126 -2,-2.3 0, 0.0 0, 0.0 0, 0.0 -0.553 360.0 360.0 94.5 360.0 29.6 36.6 16.3